AG008414

1118-92-9 | N,N-Dimethyloctanamide

AG008414

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CAS Number	1118-92-9
Catalog Number	AG008414(AGN-PC-0JKBMR)
Chemical Name	N,N-Dimethyloctanamide
EC Number	214-272-5
IUPAC Name	N,N-dimethyloctanamide
InChI	InChI=1S/C10H21NO/c1-4-5-6-7-8-9-10(12)11(2)3/h4-9H2,1-3H3
InChI Key	VHRUBWHAOUIMDW-UHFFFAOYSA-N
MDL Number	MFCD00043763
Molecular Formula	C10H21NO
Molecular Weight	171.2798
SMILES	CCCCCCCC(=O)N(C)C
UNII	QO63R4XJMK
Synonyms	N,N-Dimethyloctanamide, 1118-92-9, N,N-Dimethylcaprylamide, OCTANAMIDE, N,N-DIMETHYL-, UNII-QO63R4XJMK, BRN 1754903, EINECS 214-272-5, QO63R4XJMK, AI3-26660, NN-Dimethyloctanamide, NN-Dimethylcaprylamide, DSSTox_CID_7364, EC 214-272-5, AC1L23ET, DSSTox_RID_78425, DSSTox_GSID_27364, SCHEMBL168214, CHEMBL3181960, DTXSID9027364, CTK0I0925, VHRUBWHAOUIMDW-UHFFFAOYSA-N, KS-00000GQ1, ZINC2039897, Tox21_301930, 2111AA, ANW-57413, MFCD00043763, SBB007989, AKOS006228697, FR-0709, MCULE-6939177208, NCGC00255366-01, AK-87625, AN-48558, AS-10132, LS-97815, CAS-1118-92-9, DB-080742, TR-002329, FT-0655213, FT-0655393, 118D929, A802439, I14-2801, I14-6844, W-109644, n,n-dimethyloctamide, N,N-Dimethyl Octanamide, C10H21NO, C10-H21-N-O, CID14240, 3-04-00-00128 (Beilstein Handbook Reference),

Complexity	121
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	171.162g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	171.284g/mol
Monoisotopic Mass	171.162g/mol
Rotatable Bond Count	6
Topological Polar Surface Area	20.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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